LMPK15040005
  LIPID_MAPS_STRUCTURE_DATABASE

 27 27  0  0  0  0  0  0  0  0999 V2000
   -1.2861    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2861   -0.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5716   -0.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1429   -0.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1429    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5716    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5593   -1.1485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8747    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6880   -0.4898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6880   -1.1498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2861   -0.2011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5951    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3151    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0351    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7551    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4751    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1951    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9151    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6351    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3551    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0751    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7951    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5151    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2351    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9551    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6751    1.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3951    0.7373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  5  8  1  0  0  0  0
  4  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK15040005

> <COMMON_NAME>
6-((8Z,11Z,14Z)-heptadeca-8,11,14-trien-1-yl)salicylic acid

> <SYSTEMATIC_NAME>
2-((8Z,11Z,14Z)-heptadeca-8,11,14-trien-1-yl)-6-hydroxybenzoic acid

> <FORMULA>
C24H34O3

> <MASS>
370.25

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Anacardic acids and derivatives [PK1504]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MBYMHCHZLAJVRK-PDBXOOCHSA-N

> <INCHI>
InChI=1S/C24H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h3-4,6-7,9-10,17,19-20,25H,2,5,8,11-16,18H2,1H3,(H,26,27)/b4-3-,7-6-,10-9-

> <SMILES>
C1C=C(CCCCCCC/C=C\C/C=C\C/C=C\CC)C(C(O)=O)=C(O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186627

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10067772

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$